COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK230375
Chemical Name: 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-({5-[(2-methoxyphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Smiles: C=CCn1c(SCC(=O)N2CCc3c(C2)cccc3)nnc1COc1ccccc1OC

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Molecular Weight: 450.56
Empirical Formula: C24H26N4O3S

Physical State: Dry powder
Available Amount: 179 mg

Lipinsky:
logP: 4.558
Rotatable bonds: 9
H-donors: 0
H-acceptors: 3
PSA: 94
Number of rings: 4

     

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